Search results for "thiophene"

showing 4 items of 284 documents

4,4'-[Thiophene-2,5-diylbis(ethyne-2,1-diyl)]dibenzonitrile

2008

In the solid state, the title compound, C(22)H(10)N(2)S, forms centrosymmetric dimers by pairs of non-classical C-H⋯S hydrogen bonds linking approximately coplanar mol-ecules. The benzene ring involved in this inter-action makes a dihedral angle of only 7.21 (16)° with the thio-phene ring, while the other benzene ring is twisted somewhat out of the plane, with a dihedral angle of 39.58 (9)°. The hydrogen-bonded dimers stack on top of each other with an inter-planar spacing of 3.44 Å. C-H⋯N hydrogen bonds link together stacks that run in approximately perpendicular directions. Each mol-ecule thus inter-acts with 12 adjacent mol-ecules, five of them approaching closer than the sum of the van …

optoelectronicsmolecular electronicsSolid-state.Dihedral angle010402 general chemistryRing (chemistry)BioinformaticsOrganic Papers01 natural sciencesnanoelectronicsFaculdade de Ciências Exatas e da Engenhariasymbols.namesakechemistry.chemical_compound44000-[Thiophene-25-diylbis(ethyne-21diyl)]dibenzonitrilePerpendicularPhysics::Atomic and Molecular ClustersGeneral Materials ScienceVan der Waals radiusPhysics::Chemical PhysicsBenzene010405 organic chemistryChemistryHydrogen bondGeneral ChemistryCondensed Matter Physics3. Good health0104 chemical sciencesCrystallographysymbolsorganic compoundsActa Crystallographica Section E: Crystallographic Communications
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Preparation of tungstophosphoric acid/cerium-doped NH2-UiO-66 Z-scheme photocatalyst: a new candidate for green photo-oxidation of dibenzothiophene a…

2021

International audience; The goal of this study was to introduce an effective visible-light induced photocatalytic system with a good ability for photocatalytic oxidative desulfurization (PODS) and denitrogenation (PODN) using molecular oxygen (O2) as an oxidant. In this regard, tungestophosphoric acid (PW12) was supported onto cerium-doped NH2-UiO-66 (PW12/Ce-NUiO-66) and employed for the photo-oxidation of dibenzothiophene (DBT) and quinoline (Qu). Herein, using cerium (Ce) as a “mediator” facilitated the separation of charge carriers, while NH2-UiO-66 remarkably enhanced the surface area with plentiful adsorption sites and shifted the adsorption edge of PW12to the visible region. The sum …

pore volumeAdsorption edgesLight02 engineering and technology01 natural scienceschemistry.chemical_compound[SPI]Engineering Sciences [physics]quinolineVisible-light irradiationMaterials Chemistryoxidizing agentOxidative desulfurizationirradiationQuinolineCerium021001 nanoscience & nanotechnologyOxidantsFlue-gas desulfurizationCeriumDibenzothiophenePhotocatalysisCharge carrierCarrier mobility0210 nano-technologychemistry.chemical_element010402 general chemistryMaximum EfficiencyCatalysisArticleuraniumAdsorptionphosphotungstic acidpore size distributiondibenzothiophene derivativegreen chemistryphotooxidationDopingdesulfurizationGeneral Chemistrysurface areaPhotocatalytic systems0104 chemical sciencesVisible light inducedDibenzothiophenesTungstophosphoric acidMolecular oxygenPhotocatalytic activitychemistryadsorptiondesorptionoxygenphotocatalysisNuclear chemistrycatalyst
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Studies in organic mass spectrometry. Part 23. Role of the aroyl group on the competitive fragmentation reactions of the molecular ion of aroylanilid…

1999

The 70 eV and mass-analysed ion kinetic energy (MIKE) spectra of some thiophenecarboxanilides and benzoylanilides (1–10) have been compared in order to investigate the role of the aroyl (or heteroaroyl) moiety on the abundance of the competitive fragmentation reactions occurring in their molecular ions (amide–bond cleavage and phenol radical ion formation). It has been shown that the electron ionisation induced decompositions with high (70 eV) and low (MIKE) internal energy excess are qualitatively similar, but remarkable quantitative differences have been observed that can be accounted for in terms of the different effectiveness in the transmission of electronic effects of substituents in …

substituent effectsChemistryrearrangement processesPolyatomic ionAnalytical chemistryaroylanilidesMass spectrometryPhotochemistryelectron ionisation; positive ions; ion chemistry; aroylanilides; substituent effects; rearrangement processesIonchemistry.chemical_compoundRadical ionFragmentation (mass spectrometry)positive ionsThiopheneElectronic effectMoietyion chemistryelectron ionisationSpectroscopy
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Synthesis, antiproliferative activity, and in silico insights of new 3-benzoylamino-benzo[ b ]thiophene derivatives

2014

A new series of 3-benzoylamino-5-imidazol-5-yl-benzo[b]thiophenes and the parent amino derivatives were synthesized and screened as antitumor agents. All tested compounds showed concentration-dependent antiproliferative activity profile against HeLa cell line, exhibiting GI50 values in the low micromolar range. The most active compounds were tested in cell cycle perturbation experiments. A rapid accumulation of cells in the G2/M phase, with a concomitant reduction of cells in both the S and G0/G1 phases, was observed, suggesting that cell exposure to selected derivatives produces mitotic failure. To rationalize the biological results, the 3-benzoylamino-benzo[b]thiophenes were analyzed thro…

thiopheneVLAK protocolStereochemistryIn silicoCellAntineoplastic AgentsMechanism of actionHeLa CellHeLaAntineoplastic AgentStructure-Activity Relationship3-Benzoylamino-5-imidazol-4-yl-benzo[b]Settore BIO/10 - BiochimicaDrug DiscoverymedicineHumansMoietyComputer SimulationMitosisCell ProliferationPharmacologyAntitumor agentsbiologyDose-Response Relationship DrugMolecular StructureChemistryDrug Discovery3003 Pharmaceutical ScienceMedicine (all)Cell CycleOrganic ChemistryAntitumor agentG2/M phaseGeneral MedicineSettore CHIM/06 - Chimica OrganicaHeLa cell linebiology.organism_classificationSettore CHIM/08 - Chimica Farmaceuticamedicine.anatomical_structureCell cultureSettore CHIM/03 - Chimica Generale E InorganicathiophenesAntimitotic AgentTopoisomerase-II InhibitorDrug Screening Assays AntitumorHeLa CellsHuman
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